SCHEMBL4595989

SCHEMBL4595989

CC(C)(c1ccc(C(C)(c2ccc(O)c(C(O)O)c2)c2ccc(O)c(C(O)O)c2)cc1)c1ccc(O)c(C(O)O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.56
ESR1 P03372 7/20 0.48
ESR2 Q92731 6/20 0.46
KLF10 Q13118 1/20 0.43
ALOX15 P16050 2/20 0.41
ALOX12 P18054 1/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CYP3A4 P08684 2/20 0.41
AR P10275 2/20 0.41
TSHR P16473 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
HTR6 P50406 1/20 0.41
ESRRG P62508 1/20 0.41
SLC6A3 Q01959 1/20 0.41
CACNA1B Q00975 1/20 0.39
ALDH1A1 P00352 3/20 0.37
TDP1 Q9NUW8 1/20 0.37
CNR1 P21554 3/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL224430 0.91 RORC (0.65) RORCESR1ESR2KLF10ALOX15
SCHEMBL31143653 0.88 ESR1 (0.57) RORCESR1ESR2KLF10ALOX15
SCHEMBL5526772 0.86 RORC (0.56) RORCESR1ESR2KLF10ALOX15
SCHEMBL2950255 0.80 ALDH1A1 (0.59) RORCESR1ESR2KLF10ALOX15
SCHEMBL15961485 0.80 ALDH1A1 (0.59) RORCESR1ESR2KLF10ALOX15
SCHEMBL209049 0.78 ESR1 (0.80) RORCESR1ESR2KLF10ALOX15
SCHEMBL11180575 0.78 RORC (0.68) RORCESR1ESR2KLF10ALOX15
SCHEMBL29375957 0.78 ESR1 (0.80) RORCESR1ESR2KLF10ALOX15
SCHEMBL29395733 0.76 RORC (0.70) RORCESR1ESR2KLF10ALOX15
SCHEMBL29350897 0.76 RORC (0.70) RORCESR1ESR2KLF10ALOX15

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0843218-B1 Photosensitive composition FUJIFILM CORP (JP) 2008-01-16 EP disclosed
EP-1248149-A1 Photosensitive lithographic printing plate FUJI PHOTO FILM CO., LTD. (JP) 2002-10-09 EP disclosed
EP-1077392-A1 Photosensitive lithographic printing plate FUJI PHOTO FILM CO., LTD. (JP) 2001-02-21 EP disclosed
EP-0713143-B1 Photosensitive planographic printing plate FUJI PHOTO FILM CO LTD (JP) 2000-04-26 EP disclosed
EP-0843218-A1 Photosensitive composition FUJI PHOTO FILM CO., LTD. (JP) 1998-05-20 EP disclosed